CAS Registry Number®
512-04-9
CAS Name
Diosgenin
Molecular Formula
C27H42O3
Molecular Mass
414.62
Compound Properties
-
Melting Point (1)
205.5 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1
InChIKey
InChIKey=WQLVFSAGQJTQCK-VKROHFNGSA-N
SMILES
C[C@@H]1[C@]2(O[C@@]3([C@]1([C@]4(C)[C@@](C3)([C@]5([C@](CC4)([C@]6(C)C(=CC5)C[C@@H](O)CC6)[H])[H])[H])[H])[H])CC[C@@H](C)CO2
Canonical SMILES
OC1CC2=CCC3C(CCC4(C)C3CC5OC6(OCC(C)CC6)C(C)C54)C2(C)CC1
Other Names for this Substance
- Spirost-5-en-3-ol, (3β,25R)-
- Spirost-5-en-3β-ol, (25R)-
- 25D-Spirost-5-en-3β-ol
- Spiro[8H-naphth[2′,1′:4,5]indeno[2,1-b]furan-8,2′-[2H]pyran], spirost-5-en-3-ol deriv.
- (3β,25R)-Spirost-5-en-3-ol
- Diosgenin
- Nitogenin
- (25R)-Spirost-5-en-3β-ol
- 25α-Spirost-5-en-3β-ol
- NSC 33396
- MeSH ID: D004144
